In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2008 | 28 | Yes |
Popular Name: 4-[[4-(3,5-dimethoxybenzoyl)-1,4-diazepan-1-yl]methyl]benzonitrile 4-[[4-(3,5-dimethoxybenzoyl)-1,4…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.26 | 9.89 | -58.59 | 1 | 6 | 1 | 67 | 380.468 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.